Lobelanidine (R)-2-((2R,6S)-6-((S)-2-羟基-2-苯乙基)-1-甲基哌啶-2-基)-1-苯乙醇 （洛贝林盐酸盐杂质）

CAS 552-72-7 MFCD N/A

化学结构图

552-72-7
SMILES: CN1C(CC(O)c2ccccc2)CCCC1CC(O)c1ccccc1

化学属性

Mol. FormulaC22H29NO2
Mol. Weight339.47
Melting Point150 °C
Boiling Point475.43 °C at 760 mmHg

别名和识别编码

Synonym (R)-2-((2R,6S)-6-((S)-2-Hydroxy-2-phenylethyl)-1-methylpiperidin-2-yl)-1-phenylethanol (Lobeline Hydrochloride Impurity) {LY} (R)-2-((2R,6S)-6-((S)-2-Hydroxy-2-phenylethyl)-1-methylpiperidin-2-yl)-1-phenylethanol (Lobeline Hydrochloride Impurity) lobelanidine {} {LY} (R)-2-((2R,6S)-6-((S)-2-Hydroxy-2-phenylethyl)-1-methylpiperidin-2-yl)-1-phenylethanol (Lobeline Hydrochloride Impurity) {} {} {LY} (R)-2-((2R,6S)-6-((S)-2-Hydroxy-2-phenylethyl)-1-methylpiperidin-2-yl)-1-phenylethanol (Lobeline Hydrochloride Impurity) {} {} {} {LY} (R)-2-((2R,6S)-6-((S)-2-Hydroxy-2-phenylethyl)-1-methylpiperidin-2-yl)-1-phenylethanol (Lobeline Hydrochloride Impurity) {} {} {} {} {LY} (R)-2-((2R,6S)-6-((S)-2-Hydroxy-2-phenylethyl)-1-methylpiperidin-2-yl)-1-phenylethanol (Lobeline Hydrochloride Impurity) {} {} {} {} {} {LY} (R)-2-((2R,6S)-6-((S)-2-Hydroxy-2-phenylethyl)-1-methylpiperidin-2-yl)-1-phenylethanol (Lobeline Hydrochloride Impurity) {} {} {} {} {} {} {LY} (R)-2-((2R,6S)-6-
Wiswesser Line NotationT6NTJ A1 B1YQR& F1YQR
Chemical NameLobelanidine
CAS Number552-72-7
Beilstein Registry Number5789266
Chemical Name Translation (R)-2-((2R,6S)-6-((S)-2-羟基-2-苯乙基)-1-甲基哌啶-2-基)-1-苯乙醇 （洛贝林盐酸盐杂质）
Canonical SMILESO[C@@H](C1=CC=CC=C1)C[C@@H]2N([C@@H](CCC2)C[C@@H](C3=CC=CC=C3)O)C
PubChem Substance ID442646
InChIInChI=1S/C22H29NO2/c1-23-19(15-21(24)17-9-4-2-5-10-17)13-8-14-20(23)16-22(25)18-11-6-3-7-12-18/h2-7,9-12,19-22,24-25H,8,13-16H2,1H3/t19-,20+,21-,22+
MDL NumberMFCD32869233
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安全信息

RTECSTM7132400 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 18 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems
   Laboratory, NIOSH Exchange Chemicals.  (Aberdeen Proving Ground, MD 21010)
   Volume(issue)/page/year: NX#11790

Storage condition

系列性分类

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